[2-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoylamino)-2-oxidanylidene-ethyl] 2-(1,3-benzothiazol-2-ylmethylsulfanyl)ethanoate

Systemtic Name: [2-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoylamino)-2-oxidanylidene-ethyl] 2-(1,3-benzothiazol-2-ylmethylsulfanyl)ethanoate Openeye Name: [2-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoylamino)-2-oxo-ethyl] 2-(1,3-benzothiazol-2-ylmethylsulfanyl)acetate CAS Name: 2-(1,3-benzothiazol-2-ylmethylthio)acetic acid [2-[[(2,3-dihydro-1,4-benzodioxin-6-ylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoylamino)-2-oxoethyl] 2-(1,3-benzothiazol-2-ylmethylsulfanyl)acetate Traditional Name: 2-(1,3-benzothiazol-2-ylmethylthio)acetic acid [2-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoylamino)-2-keto-ethyl] ester Formula: C21H19N3O6S2 MolecularWeight: 473.52206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)NC(=O)NC(=O)COC(=O)CSCC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)NC(=O)NC(=O)COC(=O)CSCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H19N3O6S2/c25-18(24-21(27)22-13-5-6-15-16(9-13)29-8-7-28-15)10-30-20(26)12-31-11-19-23-14-3-1-2-4-17(14)32-19/h1-6,9H,7-8,10-12H2,(H2,22,24,25,27)